2-[4-(phenylmethyl)piperazin-1-yl]ethyl 2-phenylethanoate dihydrochloride

Systemtic Name: 2-[4-(phenylmethyl)piperazin-1-yl]ethyl 2-phenylethanoate dihydrochloride Openeye Name: 2-(4-benzylpiperazin-1-yl)ethyl 2-phenylacetate dihydrochloride CAS Name: 2-phenylacetic acid 2-[4-(phenylmethyl)-1-piperazinyl]ethyl ester dihydrochloride IUPAC Name: 2-(4-benzylpiperazin-1-yl)ethyl 2-phenylacetate dihydrochloride Traditional Name: 2-phenylacetic acid 2-(4-benzylpiperazino)ethyl ester dihydrochloride Formula: C42H54Cl2N4O4 MolecularWeight: 749.80856

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCOC(=O)CC2=CC=CC=C2)CC3=CC=CC=C3.C1CN(CCN1CCOC(=O)CC2=CC=CC=C2)CC3=CC=CC=C3.Cl.Cl

Isomeric SMILES

C1CN(CCN1CCOC(=O)CC2=CC=CC=C2)CC3=CC=CC=C3.C1CN(CCN1CCOC(=O)CC2=CC=CC=C2)CC3=CC=CC=C3.Cl.Cl

InChI

InChI=1S/2C21H26N2O2.2ClH/c2*24-21(17-19-7-3-1-4-8-19)25-16-15-22-11-13-23(14-12-22)18-20-9-5-2-6-10-20;;/h2*1-10H,11-18H2;2*1H